Co-crystal Structure of PERK bound to 4-{2-amino-4-methyl-3-[2-(methylamino)-1,3-benzothiazol-6-yl]benzoyl}-1-methyl-2,5-diphenyl-1,2-dihydro-3H-pyrazol-3-one inhibitor

Co-crystal Structure of PERK bound to 4-{2-amino-4-methyl-3-[2-(methylamino)-1,3-benzothiazol-6-yl]benzoyl}-1-methyl-2,5-diphenyl-1,2-dihydro-3H-pyrazol-3-one inhibitor Descriptor: 4-{2-amino-4-methyl-3-[2-(methylamino)-1,3-benzothiazol-6-yl]benzoyl}-1-methyl-2,5-diphenyl-1,2-dihydro-3H-pyrazol-3-one, Eukaryotic translation initiation factor 2-alpha kinase 3,Eukaryotic translation initiation factor 2-alpha kinase 3, GLYCEROL, ... Authors: Shaffer, P.L, Long, A.M, Chen, H. Deposit date: 2014-12-09 Release date: 2015-01-28 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Discovery of 1H-Pyrazol-3(2H)-ones as Potent and Selective Inhibitors of Protein Kinase R-like Endoplasmic Reticulum Kinase (PERK). J.Med.Chem., 58, 2015

PERK与4-{2-氨基-4-甲基-3-[2-(甲氨基)-1,3-苯并噻唑-6-基]苯甲酰基}-1-甲基-2,5-二苯基-1,2-二氢-3H-吡唑-3-酮抑制剂共晶结构
结构描述：该共晶体系涉及抑制剂4-{2-氨基-4-甲基-3-[2-(甲氨基)-1,3-苯并噻唑-6-基]苯甲酰基}-1-甲基-2,5-二苯基-1,2-二氢-3H-吡唑-3-酮、真核翻译起始因子2α激酶3（Eukaryotic translation initiation factor 2-alpha kinase 3、真核翻译起始因子2α激酶3（Eukaryotic translation initiation factor 2-alpha kinase 3）以及甘油（GLYCEROL）等
作者：Shaffer, P.L.、Long, A.M.、Chen, H.
沉积日期：2014-12-09
发布日期：2015-01-28
最后修改日期：2024-02-28
实验方法：X射线衍射（分辨率1.9 Å）
引用文献：《1H-吡唑-3(2H)-酮类化合物作为强效且选择性的蛋白激酶R样内质网激酶（PERK）抑制剂的发现》，《药物化学杂志》（J.Med.Chem.，第58卷，2015年